CHEBI:171828 - Allyl nonanoate

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ChEBI Name Allyl nonanoate
ChEBI ID CHEBI:171828
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H22O2
Net Charge 0
Average Mass 198.306
Monoisotopic Mass 198.16198
InChI InChI=1S/C12H22O2/c1-3-5-6-7-8-9-10-12(13)14-11-4-2/h4H,2-3,5-11H2,1H3
InChIKey MFLWLDDOGSNSKO-UHFFFAOYSA-N
SMILES O(C(=O)CCCCCCCC)CC=C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in Pooled sample (NCIT:C45910). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing Allyl nonanoate (CHEBI:171828) is a fatty acid ester (CHEBI:35748)
IUPAC Name
prop-2-enyl nonanoate
Manual Xrefs Databases
55339 ChemSpider
HMDB0029763 HMDB
LMFA07010778 LIPID MAPS
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Registry Number Type Source
7493-72-3 CAS Registry Number ChemIDplus